5-Methylbenzo(b)thiophene
TL;DR: 5-Methylbenzo(b)thiophene (CAS 14315-14-1) is a chemical compound with molecular formula C9H8S and molecular weight 148.03467 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-1-benzothiophene
Also Known As: 5-Methylbenzo[b]thiophene, 5-Methyl-1-benzothiophene, 5-Methylthianaphthene, 5-Methylbenzo(b)thiophene, 5-methylbenzothiophene
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H8S |
| Molecular Weight | 148.03467 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 148.03467 Da |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
| SMILES | CC1=CC2=C(C=C1)SC=C2 |
| InChIKey | DOHZWDWNQFZIKH-UHFFFAOYSA-N |
Chemical Property Profile of 5-Methylbenzo(b)thiophene
Property Insights of 5-Methylbenzo(b)thiophene
The XLogP value of 3.3 indicates that 5-Methylbenzo(b)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 5-Methylbenzo(b)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methylbenzo(b)thiophene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Methylbenzo(b)thiophene?
The CAS number of 5-Methylbenzo(b)thiophene is 14315-14-1.
What is the molecular formula of 5-Methylbenzo(b)thiophene?
The molecular formula of 5-Methylbenzo(b)thiophene is C9H8S.
What is the molecular weight of 5-Methylbenzo(b)thiophene?
The molecular weight of 5-Methylbenzo(b)thiophene is 148.03467 g/mol.
Where can I buy 5-Methylbenzo(b)thiophene?
You can request a quote for 5-Methylbenzo(b)thiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Methylbenzo(b)thiophene?
Yes, CoreyChem provides custom synthesis services for 5-Methylbenzo(b)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.